[
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    "molid": "mol32132",
    "smiles": "CC(C)(C)c1cc(/C=C/c2n[nH]c(O)n2)cc(C(C)(C)C)c1O",
    "microspecies": [
      {
        "id": "-1_1",
        "charge": -1,
        "smiles": "CC(C)(C)c1cc(/C=C/c2n[nH]c([O-])n2)cc(C(C)(C)C)c1O",
        "std_free_energy": 1.976845145225525,
        "relative_population": 0.09851545757396049
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        "id": "-1_2",
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        "smiles": "CC(C)(C)c1cc(/C=C/c2n[n-]c(O)n2)cc(C(C)(C)C)c1O",
        "std_free_energy": 0.30023953318595886,
        "relative_population": 0.5267990031484642
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        "id": "-1_3",
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        "smiles": "CC(C)(C)c1cc(/C=C/c2n[nH]c(O)n2)cc(C(C)(C)C)c1[O-]",
        "std_free_energy": 0.6410729885101318,
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        "id": "-2_1",
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        "smiles": "CC(C)(C)c1cc(/C=C/c2n[n-]c([O-])n2)cc(C(C)(C)C)c1O",
        "std_free_energy": 9.824027061462402,
        "relative_population": 0.39872783657767824
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      {
        "id": "-2_2",
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        "smiles": "CC(C)(C)c1cc(/C=C/c2n[n-]c(O)n2)cc(C(C)(C)C)c1[O-]",
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        "relative_population": 0.32633999031398925
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      {
        "id": "-2_3",
        "charge": -2,
        "smiles": "CC(C)(C)c1cc(/C=C/c2n[nH]c([O-])n2)cc(C(C)(C)C)c1[O-]",
        "std_free_energy": 10.195781707763672,
        "relative_population": 0.2749321731083326
      }
    ],
    "macro_pka_values": [
      {
        "pka_value": 10.3,
        "charge_state_pre": -1,
        "charge_state_post": -2,
        "data_source": "OCHEM"
      }
    ]
  }
]